3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine
Basic information
- CAS
208519-15-7- Standard SMILES
Nc1cc(-c2ccc3c(c2)OCO3)[nH]n1- InChIKey
AKOLIWNDJVYUDV-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2
- Average molar mass
- 203.2 g/mol
- Monoisotopic mass
- 203.06947654
Names & identifiers
- Preferred name
- 3-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine
- IUPAC
- 5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-amine
- English name
- 3-(1,3-Benzodioxol-5-yl)-1H-pyrazol-5-amine
- Molecular formula
- C10H9N3O2
- Molecular weight
- 203.2
Names & synonyms
208519-15-73-(1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine3-(Benzo[d][1,3]dioxol-5-yl)-1H-pyrazol-5-amine5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-amineMFCD085582395-(1,3-dioxaindan-5-yl)-1H-pyrazol-3-amine3-(2H-1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine5-(Benzo[d][1,3]dioxol-5-yl)-1H-pyrazol-3-amine5-(2H-1,3-benzodioxol-5-yl)-1H-pyrazol-3-amineSCHEMBL6250827SCHEMBL6960194DTXSID801260029
Show more names
1H-Pyrazol-3-amine, 5-(1,3-benzodioxol-5-yl)-
SBB093099AKOS000188512KC-0209CS-0169771EN300-11505043-(1,3-benzodioxol-5-yl)-1H-pyrazol-5- amine3-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)pyrazole-5-ylamine
Database identifiers
- CAS
208519-15-7- PubChem CID
- 19616634
- DTXSID
DTXSID801260029
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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